5-nitro-2-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]benzenecarbonitrile

Systemtic Name: 5-nitro-2-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]benzenecarbonitrile Openeye Name: 5-nitro-2-[4-[(E)-styryl]sulfonylpiperazin-1-yl]benzonitrile CAS Name: 5-nitro-2-[4-[(E)-2-phenylethenyl]sulfonyl-1-piperazinyl]benzonitrile IUPAC Name: 5-nitro-2-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]benzonitrile Traditional Name: 5-nitro-2-[4-[(E)-styryl]sulfonylpiperazino]benzonitrile Formula: C19H18N4O4S MolecularWeight: 398.43562

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=C(C=C2)[N+](=O)[O-])C#N)S(=O)(=O)C=CC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1C2=C(C=C(C=C2)[N+](=O)[O-])C#N)S(=O)(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C19H18N4O4S/c20-15-17-14-18(23(24)25)6-7-19(17)21-9-11-22(12-10-21)28(26,27)13-8-16-4-2-1-3-5-16/h1-8,13-14H,9-12H2/b13-8+